SCHEMBL8250419

SCHEMBL8250419

C=C(/C=C/c1cccc(-c2nc3ccccc3n2CCc2ccc(OC)cc2)c1)NO

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 19/20 0.66
HDAC8 Q9BY41 19/20 0.66
HDAC6 Q9UBN7 18/20 0.66
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
HIF1A Q16665 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8250414 0.92 HDAC1 (0.65) HDAC1HDAC8HDAC6
SCHEMBL5565828 0.90 HDAC1 (0.81) HDAC1HDAC8HDAC6
SCHEMBL5565825 0.90 HDAC1 (0.81) HDAC1HDAC8HDAC6
SCHEMBL8243386 0.88 HDAC1 (0.69) HDAC1HDAC8HDAC6
SCHEMBL8252542 0.87 HDAC1 (0.70) HDAC1HDAC8HDAC6
SCHEMBL8243394 0.86 HDAC1 (0.58) HDAC1HDAC8HDAC6ALDH1A1HPGD
SCHEMBL8249455 0.85 HDAC1 (0.81) HDAC1HDAC8HDAC6
SCHEMBL8249453 0.84 HDAC1 (0.68) HDAC1HDAC8HDAC6
SCHEMBL5565801 0.82 HDAC1 (0.80) HDAC1HDAC8HDAC6
SCHEMBL5566420 0.82 HDAC1 (0.80) HDAC1HDAC8HDAC6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7169801-B2 Histone deacetylase inhibitors TAKEDA SAN DIEGO, INC. (US) 2007-01-30 US disclosed
US-20040266769-A1 Histone deacetylase inhibitors SYRRX, INC. 2004-12-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040266769-A1 Histone deacetylase inhibitors HDAC1, HDAC11, HDAC10 HDAC1 1/4885HDAC8 10/4885HDAC6 11/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.